Fluorobenzene
TL;DR: Fluorobenzene (CAS 462-06-6) is a chemical compound with molecular formula C6H5F and molecular weight 96.03753 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
fluorobenzene
Also Known As: FLUOROBENZENE, Phenyl fluoride, Monofluorobenzene, Benzene, fluoro-, 4-fluorobenzene
Application Areas
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H5F |
| Molecular Weight | 96.03753 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 96.03753 Da |
| Heavy Atoms | 7 |
| Complexity | 46.0 |
| Melting Point | -42.2 °F (NTP, 1992) |
| Boiling Point | 185.2 °F at 760 mmHg (NTP, 1992) |
| Density | 1.0225 at 68 °F (USCG, 1999) - Denser than water; will sink |
| Flash Point | 5 °F (NTP, 1992) |
| Vapor Pressure | 60 mmHg at 67.3 °F ; 100 mmHg at 86.7 °F (NTP, 1992) |
| Solubility | 1 to 10 mg/mL at 68 °F (NTP, 1992) |
| SMILES | C1=CC=C(C=C1)F |
| InChIKey | PYLWMHQQBFSUBP-UHFFFAOYSA-N |
Product Description
Applications: Fluorobenzene is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Fluorobenzene (CAS 462-06-6) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A heterocyclic building block supplied by CoreyChem, Fluorobenzene (CAS 462-06-6) has the molecular formula C6H5F and a molecular weight of 96.04 g/mol. Reported properties include a density of 1.0225 at 68 °F (USCG, 1999) - Denser than water; will sink g/cm³, a solubility: 1 to 10 mg/mL at 68 °F (NTP, 1992). It is also known as FLUOROBENZENE and Phenyl fluoride.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Fluorobenzene
Property Insights of Fluorobenzene
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Fluorobenzene. With a topological polar surface area (TPSA) of 0.0 Ų, Fluorobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Fluorobenzene has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Fluorobenzene?
The CAS number of Fluorobenzene is 462-06-6.
What is the molecular formula of Fluorobenzene?
The molecular formula of Fluorobenzene is C6H5F.
What is the molecular weight of Fluorobenzene?
The molecular weight of Fluorobenzene is 96.03753 g/mol.
What are the applications of Fluorobenzene?
Fluorobenzene is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Fluorobenzene (CAS...
Where can I buy Fluorobenzene?
You can request a quote for Fluorobenzene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Fluorobenzene?
Yes, CoreyChem provides custom synthesis services for Fluorobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.